Vitas-M small molecule compound
ethyl 3-hexyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole-1-carboxylate
Catalog ID
STK010098
SMILES CCCCCCC1=NN(C(C1)(O)C(F)(F)F)C(=O)OCC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H21F3N2O3 MW 310.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H21F3N2O3/c1-3-5-6-7-8-10-9-12(20,13(14,15)16)18(17-10)11(19)21-4-2/h20H,3-9H2,1-2H3InChIKey
YNNYCZXAXMRRPR-UHFFFAOYSA-NSynonyms
2PYRAZOLINE1CARBOXYLICACID5TRIFLUOROMETHYL3HEXYL5HYDROXYETHYLESTER
CCCCCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)OCC
CCCCCCC1=NN(C(C1)(O)C(F)(F)F)C(=O)OCC
ETHYL3HEXYL5HYDROXY5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOLE1CARBOXYLATE
ETHYL3HEXYL5HYDROXY5(TRIFLUOROMETHYL)4HPYRAZOLE1CARBOXYLATE
InChI=1SC13H21F3N2O3c13567810912(2013(1415)16)18(1710)11(19)2142h20H39H212H3
MFCD02647421
STK010098
ZINC000004551129
ZINC000004551130
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